4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide

C15H29N3O — CID 62782757

IUPAC4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)NCCN1CCCCC1
InChIInChI=1S/C15H29N3O/c1-12-11-13(16)5-6-14(12)15(19)17-7-10-18-8-3-2-4-9-18/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyPHPJRJLDANXXJB-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.35
Rot. Bonds4

About 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide

4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide (PubChem CID 62782757) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide
PubChem CID62782757
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)NCCN1CCCCC1
InChIInChI=1S/C15H29N3O/c1-12-11-13(16)5-6-14(12)15(19)17-7-10-18-8-3-2-4-9-18/h12-14H,2-11,16H2,1H3,(H,17,19)
InChIKeyPHPJRJLDANXXJB-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(azepan-1-yl)ethyl]cyclopentane-1-carboxamide
CID 66008993
4-amino-2-methyl-N-[3-(2-methylpiperidin-1-yl)propyl]cyclohexane-1-carboxamide
CID 62782327
4-amino-2-methyl-N-[2-(2-piperazin-1-ylethoxy)ethyl]cyclohexane-1-carboxamide
CID 166586186
3-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119850859
4-amino-2-methyl-N-piperidin-1-ylcyclohexane-1-carboxamide
CID 83024606
4-amino-N-[2-(azepan-1-yl)ethyl]oxolane-3-carboxamide
CID 66235652
3-amino-N-[2-(4-ethylpiperazin-1-yl)ethyl]cyclohexane-1-carboxamide
CID 119901784
4-amino-2-methyl-N-[(2-methylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 55116865
4-amino-N-[4-(dimethylamino)butyl]-2-methylcyclohexane-1-carboxamide
CID 62782762
3-(aminomethyl)-N-[2-(azepan-1-yl)ethyl]cyclohexane-1-carboxamide
CID 62808201
(2S,4S)-N-[2-(azepan-1-yl)ethyl]-2-methylpiperidine-4-carboxamide
CID 120632718
4-amino-2-methyl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 62782165

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide (CID 62782757) is 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide is CC1CC(N)CCC1C(=O)NCCN1CCCCC1.
What is the InChIKey of 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is PHPJRJLDANXXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12-11-13(16)5-6-14(12)15(19)17-7-10-18-8-3-2-4-9-18/h12-14H,2-11,16H2,1H3,(H,17,19).
What are the key properties of 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide?
4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 62782757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).